diethyl (4E)-3-(phenylmethoxyamino)-4-(phenylsulfanylmethylidene)cyclopentane-1,1-dicarboxylate

Systemtic Name: diethyl (4E)-3-(phenylmethoxyamino)-4-(phenylsulfanylmethylidene)cyclopentane-1,1-dicarboxylate Openeye Name: diethyl (4E)-3-(benzyloxyamino)-4-(phenylsulfanylmethylene)cyclopentane-1,1-dicarboxylate CAS Name: (4E)-3-(phenylmethoxyamino)-4-[(phenylthio)methylidene]cyclopentane-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl (4E)-3-(phenylmethoxyamino)-4-(phenylsulfanylmethylidene)cyclopentane-1,1-dicarboxylate Traditional Name: (4E)-3-(benzoxyamino)-4-[(phenylthio)methylene]cyclopentane-1,1-dicarboxylic acid diethyl ester Formula: C25H29NO5S MolecularWeight: 455.56646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(C(=CSC2=CC=CC=C2)C1)NOCC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC(/C(=C/SC2=CC=CC=C2)/C1)NOCC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C25H29NO5S/c1-3-29-23(27)25(24(28)30-4-2)15-20(18-32-21-13-9-6-10-14-21)22(16-25)26-31-17-19-11-7-5-8-12-19/h5-14,18,22,26H,3-4,15-17H2,1-2H3/b20-18+